General Information of the Compound
| Compound ID |
CP0186855
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| Compound Name |
1-(4-fluorophenyl)-3-(1-methylpiperidin-4-yl)-5-(2-methylpyrazol-3-yl)indole
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| Structure |
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| Formula |
C24H25FN4
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| Molecular Weight |
388.49
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| Canonical SMILES |
CN1CCC(CC1)c1cn(-c2ccc(F)cc2)c2ccc(cc12)-c1ccnn1C
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| InChI |
InChI=1S/C24H25FN4/c1-27-13-10-17(11-14-27)22-16-29(20-6-4-19(25)5-7-20)24-8-3-18(15-21(22)24)23-9-12-26-28(23)2/h3-9,12,15-17H,10-11,13-14H2,1-2H3
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| InChIKey |
WRURBHLNYRDTFF-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT02060, Alpha-1A adrenergic receptor
Protein ID: PT01005, D(2) dopamine receptor